1-[5-(3-methyl-5-phenyl-4-pyridin-2-yl-1,2,3,4-tetrazol-2-yl)-1-propyl-1,2,4-triazol-3-yl]butan-1-one

Systemtic Name: 1-[5-(3-methyl-5-phenyl-4-pyridin-2-yl-1,2,3,4-tetrazol-2-yl)-1-propyl-1,2,4-triazol-3-yl]butan-1-one Openeye Name: 1-[5-[3-methyl-5-phenyl-4-(2-pyridyl)tetrazol-2-yl]-1-propyl-1,2,4-triazol-3-yl]butan-1-one CAS Name: 1-[5-[3-methyl-5-phenyl-4-(2-pyridinyl)-2-tetrazolyl]-1-propyl-1,2,4-triazol-3-yl]-1-butanone IUPAC Name: 1-[5-(3-methyl-5-phenyl-4-pyridin-2-yltetrazol-2-yl)-1-propyl-1,2,4-triazol-3-yl]butan-1-one Traditional Name: 1-[5-[3-methyl-5-phenyl-4-(2-pyridyl)tetrazol-2-yl]-1-propyl-1,2,4-triazol-3-yl]butan-1-one Formula: C22H26N8O MolecularWeight: 418.49484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=NN(C(=N1)N2N=C(N(N2C)C3=CC=CC=N3)C4=CC=CC=C4)CCC

Isomeric SMILES

CCCC(=O)C1=NN(C(=N1)N2N=C(N(N2C)C3=CC=CC=N3)C4=CC=CC=C4)CCC

InChI

InChI=1S/C22H26N8O/c1-4-11-18(31)20-24-22(28(25-20)16-5-2)30-26-21(17-12-7-6-8-13-17)29(27(30)3)19-14-9-10-15-23-19/h6-10,12-15H,4-5,11,16H2,1-3H3